1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine

C22H18N4 — CID 68976214

IUPAC1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine
SMILESC(=N/CC/N=C/c1ccc2ccccc2n1)\c1ccc2ccccc2n1
InChIInChI=1S/C22H18N4/c1-3-7-21-17(5-1)9-11-19(25-21)15-23-13-14-24-16-20-12-10-18-6-2-4-8-22(18)26-20/h1-12,15-16H,13-14H2/b23-15+,24-16+
InChIKeyANESOAVIIBCDQC-DFEHQXHXSA-N
MW338.41 g/mol
LogP4.32
Rot. Bonds5

About 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine

1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine (PubChem CID 68976214) has the molecular formula C22H18N4 and a molecular weight of 338.41 g/mol. Its IUPAC name is 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine.

Molecular Properties

Compound Name1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine
PubChem CID68976214
Molecular FormulaC22H18N4
Molecular Weight338.41 g/mol
Exact Mass338.15
IUPAC Name1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine
SMILESC(=N/CC/N=C/c1ccc2ccccc2n1)\c1ccc2ccccc2n1
InChIInChI=1S/C22H18N4/c1-3-7-21-17(5-1)9-11-19(25-21)15-23-13-14-24-16-20-12-10-18-6-2-4-8-22(18)26-20/h1-12,15-16H,13-14H2/b23-15+,24-16+
InChIKeyANESOAVIIBCDQC-DFEHQXHXSA-N
XLogP4.32
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-1-quinolin-2-yl-N-[(Z)-quinolin-2-ylmethylideneamino]methanimine
CID 6299697
copper;N-[2-(1H-benzimidazol-2-yl)ethyl]-1-quinolin-2-ylmethanimine;dichloride
CID 71816376
N-phenyl-1-quinolin-2-ylmethanimine
CID 13120185
ethyl N'-(quinolin-2-ylmethylideneamino)carbamimidothioate
CID 75275277
N-cyclopentyl-1-quinolin-2-ylmethanimine
CID 142726970
quinoline-2-carbaldehyde;hydrate
CID 158547927
N-anthracen-1-yl-1-quinolin-2-ylmethanimine
CID 134814032
N-(2-methoxyphenyl)-1-quinolin-2-ylmethanimine
CID 1284720
4-N,6-N-dimethyl-4-N,6-N-bis[(E)-quinolin-2-ylmethylideneamino]pyrimidine-4,6-diamine
CID 177496979
3-bromo-1-quinolin-2-ylprop-1-en-2-ol
CID 168664823
3-hydroxy-N-[(E)-quinolin-2-ylmethylideneamino]naphthalene-2-carboxamide
CID 118569920
4-hydroxy-N-[(E)-quinolin-2-ylmethylideneamino]benzamide
CID 139203008

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine?
The IUPAC name of 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine (CID 68976214) is 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine.
What is the SMILES notation for 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine?
The canonical SMILES for 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine is C(=N/CC/N=C/c1ccc2ccccc2n1)\c1ccc2ccccc2n1.
What is the InChIKey of 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine?
The InChIKey is ANESOAVIIBCDQC-DFEHQXHXSA-N. The full InChI is InChI=1S/C22H18N4/c1-3-7-21-17(5-1)9-11-19(25-21)15-23-13-14-24-16-20-12-10-18-6-2-4-8-22(18)26-20/h1-12,15-16H,13-14H2/b23-15+,24-16+.
What are the key properties of 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine?
1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine has a molecular weight of 338.41 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-2-yl-N-[2-(quinolin-2-ylmethylideneamino)ethyl]methanimine is sourced from PubChem (CID 68976214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).